1-[2-[(4-oxidanylidene-4aH-quinazolin-2-yl)sulfanyl]ethanoylamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[2-[(4-oxidanylidene-4aH-quinazolin-2-yl)sulfanyl]ethanoylamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[[2-[(4-oxo-4aH-quinazolin-2-yl)sulfanyl]acetyl]amino]thiourea CAS Name: 1-[[1-oxo-2-[(4-oxo-4aH-quinazolin-2-yl)thio]ethyl]amino]-3-prop-2-enylthiourea IUPAC Name: 1-[[2-[(4-oxo-4aH-quinazolin-2-yl)sulfanyl]acetyl]amino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[[2-[(4-keto-4aH-quinazolin-2-yl)thio]acetyl]amino]thiourea Formula: C14H15N5O2S2 MolecularWeight: 349.4312

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NNC(=O)CSC1=NC(=O)C2C=CC=CC2=N1

Isomeric SMILES

C=CCNC(=S)NNC(=O)CSC1=NC(=O)C2C=CC=CC2=N1

InChI

InChI=1S/C14H15N5O2S2/c1-2-7-15-13(22)19-18-11(20)8-23-14-16-10-6-4-3-5-9(10)12(21)17-14/h2-6,9H,1,7-8H2,(H,18,20)(H2,15,19,22)